N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide
TL;DR: N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide (CAS 438474-19-2) is a chemical compound with molecular formula C16H13BrN2OS and molecular weight 359.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide
Also Known As: KSC-13-204, N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide, N~1~-(6-BROMO-1,3-BENZOTHIAZOL-2-YL)-3,4-DIMETHYLBENZAMIDE
| Molecular Formula | C16H13BrN2OS |
|---|---|
| Molecular Weight | 359.99 g/mol |
| LogP | 4.92794 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 359.9932 |
| Heavy Atoms | 21 |
| Complexity | 841.4093 |
Chemical Identifiers
| CAS Number | 438474-19-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)Br)C |
Product Overview
N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide (CAS 438474-19-2), with molecular formula C16H13BrN2OS and molecular weight 359.99 g/mol. IUPAC: N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide.
Chemical Property Profile of N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide
Property Insights of N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide
The XLogP value of 4.92794 indicates that N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide?
The CAS number of N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide is 438474-19-2.
What is the molecular formula of N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide?
The molecular formula of N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide is C16H13BrN2OS.
What is the molecular weight of N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide?
The molecular weight of N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide is 359.99 g/mol.
Where can I buy N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide?
You can request a quote for N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-bromo-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.